N-butyl-2-fluorobenzamide
TL;DR: N-butyl-2-fluorobenzamide (CAS 64181-46-0) is a chemical compound with molecular formula C11H14FNO and molecular weight 195.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-2-fluorobenzamide
Also Known As: N-butyl-2-fluorobenzamide, N-Butyl-2-fluoro-benzamide, Benzamide, 2-fluoro-N-butyl-, N-n-Butyl-2-fluorobenzamide, N-butyl(2-fluorophenyl)carboxamide
| Molecular Formula | C11H14FNO |
|---|---|
| Molecular Weight | 195.11 g/mol |
| LogP | 2.3556 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 195.10594 |
| Heavy Atoms | 14 |
| Complexity | 311.91077 |
Chemical Identifiers
| CAS Number | 64181-46-0 |
|---|---|
| SMILES | CCCCNC(=O)C1=CC=CC=C1F |
Product Overview
N-butyl-2-fluorobenzamide (CAS 64181-46-0), with molecular formula C11H14FNO and molecular weight 195.11 g/mol. IUPAC: N-butyl-2-fluorobenzamide.
Chemical Property Profile of N-butyl-2-fluorobenzamide
Property Insights of N-butyl-2-fluorobenzamide
The XLogP value of 2.3556 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-2-fluorobenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-butyl-2-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-2-fluorobenzamide has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-butyl-2-fluorobenzamide?
The CAS number of N-butyl-2-fluorobenzamide is 64181-46-0.
What is the molecular formula of N-butyl-2-fluorobenzamide?
The molecular formula of N-butyl-2-fluorobenzamide is C11H14FNO.
What is the molecular weight of N-butyl-2-fluorobenzamide?
The molecular weight of N-butyl-2-fluorobenzamide is 195.11 g/mol.
Where can I buy N-butyl-2-fluorobenzamide?
You can request a quote for N-butyl-2-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-2-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-2-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.